1-(3H-benzimidazol-5-yl)-N-methyl-methanamine; ethanedioic acid

Systemtic Name: 1-(3H-benzimidazol-5-yl)-N-methyl-methanamine; ethanedioic acid Openeye Name: 1-(3H-benzimidazol-5-yl)-N-methyl-methanamine; oxalic acid CAS Name: 1-(3H-benzimidazol-5-yl)-N-methylmethanamine; oxalic acid IUPAC Name: 1-(3H-benzimidazol-5-yl)-N-methylmethanamine; oxalic acid Traditional Name: 3H-benzimidazol-5-ylmethyl(methyl)amine; oxalic acid Formula: C13H15N3O8 MolecularWeight: 341.2735

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1=CC2=C(C=C1)N=CN2.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Isomeric SMILES

CNCC1=CC2=C(C=C1)N=CN2.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C9H11N3.2C2H2O4/c1-10-5-7-2-3-8-9(4-7)12-6-11-8;2*3-1(4)2(5)6/h2-4,6,10H,5H2,1H3,(H,11,12);2*(H,3,4)(H,5,6)